%chk=000200197.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200197

0 1
O 3.152773 -1.117398 -0.928374
O -6.759494 -3.233180 0.236058
N 6.624030 -0.977365 0.192309
C -4.366957 1.102109 0.345794
C -2.862290 1.266134 0.176198
C -2.263229 0.056661 -0.020956
C -4.561343 -0.386268 0.223050
C -3.288629 -1.004468 0.008611
C -0.841528 -0.224092 -0.225574
C -2.249513 2.593322 0.213567
C -5.721460 -1.132752 0.297616
C -3.183454 -2.383514 -0.115090
C -5.580218 -2.530220 0.157337
C 0.111364 0.229012 0.698703
C -0.422229 -0.955411 -1.355781
C -4.346978 -3.164477 -0.043084
C 5.478604 -1.228344 -0.735454
C -1.281565 2.952406 -0.741653
C -2.625738 3.525304 1.196697
C 1.862117 -0.771417 -0.611703
C 4.224878 -0.690335 -0.028649
C 1.470480 -0.041565 0.517836
C 0.922858 -1.232832 -1.559358
C 6.928404 -2.195674 1.016100
C 7.838415 -0.479540 -0.533515
C -0.704024 4.223302 -0.712874
C -2.041949 4.794092 1.221286
C -1.082279 5.146795 0.267218
C 7.711772 -1.795181 2.266870
C 7.617802 0.959954 -0.999621
H -4.921616 1.661973 -0.431850
H -4.717701 1.485729 1.322108
H -6.702171 -0.695734 0.456256
H -2.213293 -2.858022 -0.261706
H -0.212185 0.801780 1.569674
H -1.163702 -1.297990 -2.079056
H -4.284293 -4.242503 -0.139230
H 5.332877 -2.297185 -1.002429
H 5.610696 -0.696296 -1.702957
H -0.982182 2.232086 -1.503512
H -3.367079 3.256328 1.946226
H 4.222199 0.409130 0.043621
H 4.061093 -1.144604 0.961724
H 2.192257 0.315457 1.244532
H 1.268328 -1.791425 -2.425433
H 7.484746 -2.971581 0.447050
H 5.964529 -2.659245 1.325127
H 8.120529 -1.124062 -1.393740
H 8.695875 -0.504289 0.177478
H 0.044042 4.494547 -1.456132
H -2.335572 5.510197 1.986829
H 8.724703 -1.452842 2.026347
H 7.213641 -0.969337 2.793425
H 7.797082 -2.635805 2.962941
H 6.855624 1.028413 -1.784114
H 7.277625 1.592357 -0.168113
H 8.543635 1.391595 -1.393220
H -0.630717 6.136193 0.287594
H -6.620788 -4.206320 0.136596


%chk=000200197-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200197

0 1
O 3.203111 -1.217242 -1.126330
O -6.825190 -3.307889 0.349520
N 6.716776 -1.036135 0.127220
C -4.360914 1.084416 0.573247
C -2.872501 1.295619 0.274526
C -2.283544 0.074348 -0.045309
C -4.570749 -0.398330 0.344758
C -3.317962 -0.983880 -0.014947
C -0.852414 -0.224668 -0.312664
C -2.286674 2.650651 0.285337
C -5.730919 -1.172433 0.467740
C -3.230126 -2.376818 -0.235527
C -5.633751 -2.566039 0.224188
C 0.163150 0.169735 0.596480
C -0.459213 -0.955327 -1.470915
C -4.396168 -3.167692 -0.119085
C 5.597501 -1.312572 -0.806632
C -1.166253 3.006044 -0.525522
C -2.874581 3.678669 1.082143
C 1.888926 -0.856892 -0.797254
C 4.278744 -0.816240 -0.199222
C 1.521272 -0.136371 0.367943
C 0.890638 -1.262910 -1.718080
C 6.958615 -2.150783 1.083587
C 7.949668 -0.546470 -0.542880
C -0.649788 4.316847 -0.519462
C -2.355127 4.990186 1.090060
C -1.235267 5.318582 0.291992
C 7.589623 -1.684286 2.409598
C 7.825447 0.910686 -1.027040
H -4.996344 1.711635 -0.082115
H -4.616552 1.362785 1.615914
H -6.700061 -0.746607 0.744647
H -2.272702 -2.846824 -0.481601
H -0.117559 0.723860 1.498591
H -1.220393 -1.260049 -2.198019
H -4.343128 -4.251076 -0.290530
H 5.503220 -2.394974 -1.052935
H 5.765143 -0.784624 -1.761714
H -0.713343 2.252552 -1.176051
H -3.740608 3.446658 1.712373
H 4.302532 0.285277 -0.087607
H 4.105270 -1.272190 0.797128
H 2.272771 0.183842 1.095571
H 1.194413 -1.813572 -2.613709
H 7.592938 -2.950344 0.623525
H 5.981636 -2.620523 1.305253
H 8.240813 -1.206154 -1.399285
H 8.774945 -0.603761 0.189759
H 0.207199 4.561235 -1.157633
H -2.824263 5.755654 1.718865
H 8.579383 -1.218203 2.254130
H 6.938296 -0.940328 2.900514
H 7.728297 -2.542219 3.093786
H 7.015722 1.029070 -1.770206
H 7.604301 1.576070 -0.174391
H 8.766888 1.242731 -1.503301
H -0.831050 6.336972 0.294622
H -6.661295 -4.266097 0.166548


